B7WKQ5 -OEChem-04012115343D 36 37 0 0 0 0 0 0 0999 V2000 2.7256 2.9055 0.0714 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3142 0.1073 -0.0806 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9935 0.4274 -0.1603 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2863 1.1209 0.0028 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4769 -2.1112 -0.1008 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6691 -0.3385 -0.1225 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6044 0.8634 -0.0904 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0678 -0.2631 -0.0283 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2150 -0.7860 -0.0698 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1512 -1.1377 -0.0178 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5019 -0.5844 0.0257 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 0.7415 0.0554 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9132 -2.5096 -0.0494 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5457 1.6889 0.0443 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4529 -0.0441 1.1474 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8516 1.5133 -0.6379 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5940 -2.9383 -0.0898 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0808 1.3446 0.1006 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8452 -0.9205 -1.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8555 -0.9970 0.7326 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4142 1.4925 0.7897 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3649 1.4858 -0.9641 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1261 1.0171 -0.4875 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4885 1.7466 0.0103 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3339 -1.2816 0.0334 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7232 -3.2313 -0.0429 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8892 -0.9185 1.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3830 0.7334 1.9171 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4989 -0.3668 1.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8922 1.1779 -0.7122 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8166 2.3876 0.0223 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5541 1.8270 -1.6448 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3571 -3.9971 -0.1153 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2463 1.9837 -0.7729 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8650 0.5801 0.1059 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2022 1.9507 1.0044 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 2 0 0 0 0 2 6 1 0 0 0 0 2 9 1 0 0 0 0 2 23 1 0 0 0 0 3 7 1 0 0 0 0 3 15 1 0 0 0 0 3 16 1 0 0 0 0 4 8 1 0 0 0 0 4 14 1 0 0 0 0 4 24 1 0 0 0 0 5 9 2 0 0 0 0 5 17 1 0 0 0 0 6 7 1 0 0 0 0 6 19 1 0 0 0 0 6 20 1 0 0 0 0 7 21 1 0 0 0 0 7 22 1 0 0 0 0 8 9 1 0 0 0 0 8 10 2 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 2 0 0 0 0 11 25 1 0 0 0 0 12 14 1 0 0 0 0 12 18 1 0 0 0 0 13 17 2 0 0 0 0 13 26 1 0 0 0 0 15 27 1 0 0 0 0 15 28 1 0 0 0 0 15 29 1 0 0 0 0 16 30 1 0 0 0 0 16 31 1 0 0 0 0 16 32 1 0 0 0 0 17 33 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 M END $$$$